N-Methylaniline hydrochloride

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H9N.ClH
Molecular Weight	143.614
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-Methylaniline hydrochloride

SMILES

Cl.CNC1=CC=CC=C1

InChI

InChIKey=ZCXOSDRICFIHTA-UHFFFAOYSA-N

InChI=1S/C7H9N.ClH/c1-8-7-5-3-2-4-6-7;/h2-6,8H,1H3;1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C7H9N
Molecular Weight	107.1531
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Show entries

Title	Date	PubMed
Comparative nephrotoxicity of aspirin and phenacetin derivatives.	1971 Nov 27	5128205
[Studies on the retention mechanism of N-methylaniline bonded silica for high performance liquid chromatography].	2002 May	12541934
A general approach toward the synthesis of C-nucleoside pyrazolo[1,5-a]-1,3,5-triazines and their 3',5'-bisphosphate C-nucleotide analogues as the first reported in vivo stable P2Y(1)-receptor antagonists.	2002 Nov 15	12423133
Quinoxaline chemistry. Part 15. 4-[2-Quinoxalylmethylenimino]-benzoylglutamates and -benzoates, 4-[2-quinoxalylmethyl-N-methylamino]-benzoylglutamates as analogues of classical antifolate agents. Synthesis, elucidation of structures and in vitro evaluation of antifolate and anticancer activities.	2003 Jan	12595037
Tuning copper-dioxygen reactivity and exogenous substrate oxidations via alterations in ligand electronics.	2003 Jan 22	12526654

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Substance Class	Chemical
Record UNII	423CWM3UKK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-Methylanilinium chloride

Preferred Name

English

N-Methylaniline hydrochloride

Systematic Name

English

Benzenamine, N-methyl-, hydrochloride (1:1)

Systematic Name

English

Benzenamine, N-methyl-, hydrochloride

Common Name

English

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Code System

Code

Type

Description

EPA CompTox

DTXSID70181815

PRIMARY

ECHA (EC/EINECS)

220-363-0

PRIMARY

CAS

2739-12-0

PRIMARY

PUBCHEM

12206974

PRIMARY

FDA UNII

423CWM3UKK

PRIMARY

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Related Record

Type

Details


					TH45GK410O

METHYLANILINE

PARENT -> SALT/SOLVATE

Amount:

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SMILES

InChI

Approval Year

PubMed

Patents